1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

acetic acid;azane;cyclohexanamine;dichloroplatinum

2.1.2 InChI

InChI=1S/C6H13N.2C2H4O2.2ClH.H3N.Pt/c7-6-4-2-1-3-5-6;2*1-2(3)4;;;;/h6H,1-5,7H2;2*1H3,(H,3,4);2*1H;1H3;/q;;;;;;+2/p-2

2.1.3 InChI Key

TWEQNPPRXJRHHM-UHFFFAOYSA-L

2.1.4 Canonical SMILES

CC(=O)O.CC(=O)O.C1CCC(CC1)N.N.Cl[Pt]Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. Bms182751;bmy45594;jm216

2. Acetic Acid;azane;cyclohexanamine;dichloroplatinum

3. Satraplatin (usan/inn)

4. Yhi-601

5. Akos015914237

6. D05807

7. 580s638

2.3 Create Date

2006-07-28

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₂₄Cl₂N₂O₄Pt
Molecular Weight	502.3 g/mol
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	0
Exact Mass	501.076107 g/mol
Monoisotopic Mass	501.076107 g/mol
Topological Polar Surface Area	102 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	142
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	5

Satraplatin